(3-cyanophenyl) 4-(4-chloranyl-3-methyl-phenoxy)butanoate

Systemtic Name: (3-cyanophenyl) 4-(4-chloranyl-3-methyl-phenoxy)butanoate Openeye Name: (3-cyanophenyl) 4-(4-chloro-3-methyl-phenoxy)butanoate CAS Name: 4-(4-chloro-3-methylphenoxy)butanoic acid (3-cyanophenyl) ester IUPAC Name: (3-cyanophenyl) 4-(4-chloro-3-methylphenoxy)butanoate Traditional Name: 4-(4-chloro-3-methyl-phenoxy)butyric acid (3-cyanophenyl) ester Formula: C18H16ClNO3 MolecularWeight: 329.77754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)OC2=CC=CC(=C2)C#N)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)OC2=CC=CC(=C2)C#N)Cl

InChI

InChI=1S/C18H16ClNO3/c1-13-10-15(7-8-17(13)19)22-9-3-6-18(21)23-16-5-2-4-14(11-16)12-20/h2,4-5,7-8,10-11H,3,6,9H2,1H3